methyl N'-(2-phenoxyphenyl)sulfonylcarbamimidothioate

Systemtic Name: methyl N'-(2-phenoxyphenyl)sulfonylcarbamimidothioate Openeye Name: 2-methyl-3-(2-phenoxyphenyl)sulfonyl-isothiourea CAS Name: N'-(2-phenoxyphenyl)sulfonylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2-phenoxyphenyl)sulfonylcarbamimidothioate Traditional Name: 2-methyl-3-(2-phenoxyphenyl)sulfonyl-isothiourea Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=CC=CC=C1OC2=CC=CC=C2)N

Isomeric SMILES

CS/C(=N\S(=O)(=O)C1=CC=CC=C1OC2=CC=CC=C2)/N

InChI

InChI=1S/C14H14N2O3S2/c1-20-14(15)16-21(17,18)13-10-6-5-9-12(13)19-11-7-3-2-4-8-11/h2-10H,1H3,(H2,15,16)